2,2-Dimethyl-5-methylsulfonylpentanenitrile
TL;DR: 2,2-Dimethyl-5-methylsulfonylpentanenitrile (CAS 90205-32-6) is a chemical compound with molecular formula C8H15NO2S and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-5-methylsulfonylpentanenitrile
Also Known As: 2,2-dimethyl-5-methylsulfonylpentanenitrile, 5-(Methanesulfonyl)-2,2-dimethylpentanenitrile
| Molecular Formula | C8H15NO2S |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 66.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 189.08235 |
| Heavy Atoms | 12 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 90205-32-6 |
|---|---|
| SMILES | CC(C)(CCCS(=O)(=O)C)C#N |
| InChIKey | OUIKQGRVPXOPBC-UHFFFAOYSA-N |
Product Overview
2,2-Dimethyl-5-methylsulfonylpentanenitrile (CAS 90205-32-6), with molecular formula C8H15NO2S and molecular weight 189.08 g/mol. IUPAC: 2,2-dimethyl-5-methylsulfonylpentanenitrile.
Chemical Property Profile of 2,2-Dimethyl-5-methylsulfonylpentanenitrile
Property Insights of 2,2-Dimethyl-5-methylsulfonylpentanenitrile
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-5-methylsulfonylpentanenitrile. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-5-methylsulfonylpentanenitrile. Following Lipinski's Rule of Five, 2,2-Dimethyl-5-methylsulfonylpentanenitrile has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2-Dimethyl-5-methylsulfonylpentanenitrile?
The CAS number of 2,2-Dimethyl-5-methylsulfonylpentanenitrile is 90205-32-6.
What is the molecular formula of 2,2-Dimethyl-5-methylsulfonylpentanenitrile?
The molecular formula of 2,2-Dimethyl-5-methylsulfonylpentanenitrile is C8H15NO2S.
What is the molecular weight of 2,2-Dimethyl-5-methylsulfonylpentanenitrile?
The molecular weight of 2,2-Dimethyl-5-methylsulfonylpentanenitrile is 189.08 g/mol.
Where can I buy 2,2-Dimethyl-5-methylsulfonylpentanenitrile?
You can request a quote for 2,2-Dimethyl-5-methylsulfonylpentanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-5-methylsulfonylpentanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-5-methylsulfonylpentanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.